4-[2-(2-azanyl-5-azanylidene-6-cyano-7-methylsulfanyl-pyrazolo[1,5-a]pyrimidin-3-ylidene)hydrazinyl]benzenesulfonamide

Systemtic Name: 4-[2-(2-azanyl-5-azanylidene-6-cyano-7-methylsulfanyl-pyrazolo[1,5-a]pyrimidin-3-ylidene)hydrazinyl]benzenesulfonamide Openeye Name: 4-[2-(2-amino-6-cyano-5-imino-7-methylsulfanyl-pyrazolo[1,5-a]pyrimidin-3-ylidene)hydrazino]benzenesulfonamide CAS Name: 4-[2-[2-amino-6-cyano-5-imino-7-(methylthio)-3-pyrazolo[1,5-a]pyrimidinylidene]hydrazinyl]benzenesulfonamide IUPAC Name: 4-[2-(2-amino-6-cyano-5-imino-7-methylsulfanylpyrazolo[1,5-a]pyrimidin-3-ylidene)hydrazinyl]benzenesulfonamide Traditional Name: 4-[N'-[2-amino-6-cyano-5-imino-7-(methylthio)pyrazolo[1,5-a]pyrimidin-3-ylidene]hydrazino]benzenesulfonamide Formula: C14H13N9O2S2 MolecularWeight: 403.44212

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=N)N=C2N1N=C(C2=NNC3=CC=C(C=C3)S(=O)(=O)N)N)C#N

Isomeric SMILES

CSC1=C(C(=N)N=C2N1N=C(C2=NNC3=CC=C(C=C3)S(=O)(=O)N)N)C#N

InChI

InChI=1S/C14H13N9O2S2/c1-26-14-9(6-15)11(16)19-13-10(12(17)22-23(13)14)21-20-7-2-4-8(5-3-7)27(18,24)25/h2-5,16,20H,1H3,(H2,17,22)(H2,18,24,25)